[gmx-users] a question about the content in atm-pair.out file

Cao, Yang yang.cao at ttu.edu
Fri Aug 29 07:19:33 CEST 2008

Hello all,
Sorry to bother you, I have a question about the content in the file atm-pair.out file which is generated by the command g_mindist. Here is several lines of the file:

0.000000e+00 114 72

1.000000e+01 114 72

2.000000e+01 85 66

3.000000e+01 85 65

4.000000e+01 82 66

5.000000e+01 111 71"

the first column is the time but I am not sure about the next two columns, Are they the number of atoms in each group which are caculated during the process?

Best wishes?

Department of Chemistry and Biochemistry
Tesax Tech University
Lubbock, TX 79409

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